#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fip n LYS 3 N 0.00 2.68 -2.29 0.54 4.81 -1.26 -4.64 118.16 117.99 2fip n LYS 3 Ca 0.00 0.95 -0.26 0.00 -0.87 0.00 0.00 58.31 58.13 2fip n LYS 3 Cb 0.00 -2.71 0.11 0.00 0.02 0.00 0.00 35.03 32.46 2fip n LYS 3 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 2fip s THR 4 N -0.40 2.16 0.17 3.15 -4.23 0.17 -4.90 115.64 111.77 2fip s THR 4 Ca 0.60 -0.34 0.29 0.00 -1.18 0.00 0.00 61.69 61.07 2fip s THR 4 Cb -0.49 -2.83 0.32 0.00 1.34 0.00 0.00 72.50 70.84 2fip s THR 4 CO 0.54 0.00 1.94 -0.61 -0.54 0.00 0.00 174.62 175.95 2fip h GLN 5 N -0.83 0.00 -0.01 3.99 4.15 -1.95 -1.55 115.11 118.92 2fip h GLN 5 Ca -0.41 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.01 2fip h GLN 5 Cb 1.27 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.96 2fip h GLN 5 CO 0.46 0.11 -0.00 0.54 -1.93 0.00 0.00 178.83 178.00 2fip n ARG 6 N -3.28 1.29 -1.25 1.69 1.74 -1.26 -4.90 116.66 110.69 2fip n ARG 6 Ca -0.00 -0.44 0.00 0.00 -0.77 0.00 0.00 57.85 56.64 2fip n ARG 6 Cb 0.34 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.29 2fip n ARG 6 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2fip n GLY 7 N 1.09 0.70 3.71 -0.13 0.00 -0.58 -5.05 105.19 104.92 2fip n GLY 7 Ca 0.21 -0.72 -0.35 0.00 0.00 0.00 0.00 46.02 45.17 2fip n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fip s ILE 8 N -2.00 4.48 -0.40 -0.61 -1.09 -1.26 -4.54 121.20 115.79 2fip s ILE 8 Ca 0.00 -0.18 -0.04 0.00 -2.23 0.00 0.00 60.65 58.20 2fip s ILE 8 Cb 0.00 -2.90 0.10 0.00 -1.58 0.00 0.00 42.46 38.08 2fip s ILE 8 CO 0.00 0.61 0.20 -0.31 -1.23 0.00 0.00 174.94 174.20 2fip s TYR 9 N -0.88 3.51 -0.73 3.97 1.51 0.30 -0.65 117.35 124.38 2fip s TYR 9 Ca 0.13 -2.21 0.24 0.00 -1.01 0.00 0.00 57.07 54.23 2fip s TYR 9 Cb -0.11 -3.08 0.91 0.00 -0.11 0.00 0.00 41.96 39.57 2fip s TYR 9 CO 0.02 -0.94 1.74 0.72 -1.11 0.00 0.00 175.55 175.98 2fip n HIS 10 N 4.66 0.62 -3.83 2.71 8.25 -1.26 -4.14 115.22 122.22 2fip n HIS 10 Ca -0.05 0.21 -0.35 0.00 -0.26 0.00 0.00 57.72 57.27 2fip n HIS 10 Cb 0.42 -0.84 -0.12 0.00 1.12 0.00 0.00 29.99 30.57 2fip n HIS 10 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 2fip s ASN 11 N -3.99 5.14 0.53 0.41 3.84 -1.26 -4.99 114.94 114.61 2fip s ASN 11 Ca 0.09 -2.09 0.23 0.00 0.21 0.00 0.00 52.86 51.30 2fip s ASN 11 Cb 0.12 -1.78 1.37 0.00 -0.55 0.00 0.00 41.25 40.41 2fip s ASN 11 CO 0.47 -0.50 2.02 -0.07 -2.79 0.00 0.00 177.10 176.24 2fip h LEU 12 N 7.91 0.00 -0.56 3.21 3.38 -1.88 -1.64 115.31 125.73 2fip h LEU 12 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2fip h LEU 12 Cb 1.04 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2fip h LEU 12 CO 0.66 0.00 0.00 2.29 0.09 0.00 0.00 178.44 181.48 2fip n LYS 13 N -4.41 0.14 0.01 1.13 2.85 -1.26 -2.01 118.16 114.62 2fip n LYS 13 Ca 0.07 0.40 0.11 0.00 -1.05 0.00 0.00 58.31 57.84 2fip n LYS 13 Cb 0.51 -1.78 0.02 0.00 -0.65 0.00 0.00 35.03 33.13 2fip n LYS 13 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2fip n GLU 14 N -2.04 0.18 -1.70 -1.58 1.02 -0.62 -5.00 120.64 110.90 2fip n GLU 14 Ca 0.02 -0.01 -0.40 0.00 -0.02 0.00 0.00 57.16 56.75 2fip n GLU 14 Cb 0.19 -1.55 0.03 0.00 -0.02 0.00 0.00 31.44 30.09 2fip n GLU 14 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2fip n SER 15 N -1.78 2.34 -0.49 1.62 2.88 -0.85 -4.94 113.62 112.40 2fip n SER 15 Ca 0.03 1.02 0.11 0.00 -1.33 0.00 0.00 58.87 58.70 2fip n SER 15 Cb 0.40 -1.51 0.01 0.00 -0.75 0.00 0.00 64.21 62.35 2fip n SER 15 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2fip n GLU 16 N -0.47 1.20 -3.20 -1.46 0.28 -1.26 -4.83 120.64 110.90 2fip n GLU 16 Ca 0.09 -0.99 -0.44 0.00 -0.16 0.00 0.00 57.16 55.66 2fip n GLU 16 Cb 0.42 -1.48 -0.07 0.00 1.43 0.00 0.00 31.44 31.75 2fip n GLU 16 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 2fip s TYR 17 N -2.48 3.08 0.01 -1.84 2.02 -1.26 -4.51 117.35 112.37 2fip s TYR 17 Ca 0.19 -0.56 0.02 0.00 -0.37 0.00 0.00 57.07 56.35 2fip s TYR 17 Cb 0.18 -3.43 -0.01 0.00 -0.40 0.00 0.00 41.96 38.30 2fip s TYR 17 CO 0.57 -0.97 -0.07 0.08 -1.57 0.00 0.00 175.55 173.59 2fip s VAL 18 N 2.47 0.56 0.04 0.71 1.01 -1.26 -0.67 120.40 123.25 2fip s VAL 18 Ca 0.14 -0.55 0.04 0.00 0.00 0.00 0.00 61.98 61.61 2fip s VAL 18 Cb -0.20 -0.52 -0.02 0.00 0.00 0.00 0.00 36.38 35.65 2fip s VAL 18 CO 0.12 -0.01 -0.12 0.00 0.00 0.00 0.00 175.10 175.08 2fip s ALA 19 N -0.54 1.03 0.04 5.51 0.00 -0.71 -1.91 121.76 125.18 2fip s ALA 19 Ca -0.01 -0.77 -0.03 0.00 0.00 0.00 0.00 51.96 51.14 2fip s ALA 19 Cb -0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 22.91 2fip s ALA 19 CO 0.00 0.18 0.04 0.45 0.00 0.00 0.00 175.76 176.43 2fip s SER 20 N -1.14 0.29 -0.11 0.00 0.15 -0.06 -0.71 113.70 112.13 2fip s SER 20 Ca -0.00 -0.69 0.14 0.00 0.70 0.00 0.00 55.95 56.11 2fip s SER 20 Cb -0.08 0.21 0.27 0.00 -1.71 0.00 0.00 66.02 64.71 2fip s SER 20 CO 0.01 -0.52 1.17 -0.46 1.20 0.00 0.00 173.24 174.64 2fip n ASN 21 N 0.63 2.56 0.00 5.45 6.94 -0.72 -1.24 115.26 128.88 2fip n ASN 21 Ca -0.18 -2.81 0.00 0.00 -0.02 0.00 0.00 54.58 51.57 2fip n ASN 21 Cb 0.59 -0.35 0.00 0.00 -2.36 0.00 0.00 39.78 37.66 2fip n ASN 21 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 2fip n THR 22 N -1.01 0.00 -0.04 5.53 -2.24 -1.26 -4.68 114.28 110.58 2fip n THR 22 Ca 0.14 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.84 2fip n THR 22 Cb 0.59 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.79 2fip n THR 22 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2fip n ASP 23 N 0.00 2.41 -4.40 3.42 8.00 -1.26 -4.90 116.55 119.82 2fip n ASP 23 Ca 0.00 0.01 -0.29 0.00 0.71 0.00 0.00 54.79 55.21 2fip n ASP 23 Cb 0.00 -0.18 -0.13 0.00 -0.02 0.00 0.00 41.12 40.79 2fip n ASP 23 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2fip s VAL 24 N -2.17 2.34 -0.07 2.53 1.01 -1.26 -1.03 120.40 121.75 2fip s VAL 24 Ca -0.12 -1.62 0.02 0.00 0.00 0.00 0.00 61.98 60.26 2fip s VAL 24 Cb 0.04 -2.01 0.01 0.00 0.00 0.00 0.00 36.38 34.41 2fip s VAL 24 CO 0.18 0.16 -0.13 -0.89 0.00 0.00 0.00 175.10 174.42 2fip s THR 25 N -1.01 1.22 -0.05 3.92 2.01 -0.55 -1.76 115.64 119.41 2fip s THR 25 Ca 0.14 -0.52 0.01 0.00 0.31 0.00 0.00 61.69 61.63 2fip s THR 25 Cb -0.10 -1.12 -0.03 0.00 0.01 0.00 0.00 72.50 71.26 2fip s THR 25 CO 0.06 0.38 -0.04 -0.36 -0.69 0.00 0.00 174.62 173.96 2fip s PHE 26 N 0.72 3.01 -0.00 4.92 2.99 0.12 -1.07 117.98 128.67 2fip s PHE 26 Ca -0.13 0.07 0.02 0.00 0.00 0.00 0.00 56.93 56.89 2fip s PHE 26 Cb -0.16 -1.71 -0.03 0.00 0.00 0.00 0.00 43.02 41.12 2fip s PHE 26 CO 0.03 0.39 -0.04 -0.06 -0.00 0.00 0.00 175.22 175.54 2fip s PHE 27 N -0.89 2.96 0.14 0.36 0.40 -0.83 -1.74 117.98 118.38 2fip s PHE 27 Ca 0.14 0.01 0.11 0.00 -0.60 0.00 0.00 56.93 56.59 2fip s PHE 27 Cb -0.11 -1.64 -0.04 0.00 0.51 0.00 0.00 43.02 41.74 2fip s PHE 27 CO 0.04 0.40 -0.25 -0.06 0.70 0.00 0.00 175.22 176.05 2fip s PHE 28 N -1.01 2.20 -1.08 0.36 0.40 0.15 -4.60 117.98 114.40 2fip s PHE 28 Ca 0.17 -0.39 0.29 0.00 -0.60 0.00 0.00 56.93 56.41 2fip s PHE 28 Cb -0.11 -1.17 1.18 0.00 0.51 0.00 0.00 43.02 43.43 2fip s PHE 28 CO 0.08 0.36 1.87 -1.13 0.70 0.00 0.00 175.22 177.10 2fip n SER 29 N 0.75 0.09 -3.45 1.36 3.41 -1.26 -4.41 113.62 110.11 2fip n SER 29 Ca -0.17 0.27 -0.12 0.00 -0.26 0.00 0.00 58.87 58.59 2fip n SER 29 Cb 0.54 -0.35 -0.02 0.00 -0.26 0.00 0.00 64.21 64.12 2fip n SER 29 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2fip s SER 30 N -2.92 -0.53 0.34 4.04 1.04 -1.26 -0.54 113.70 113.87 2fip s SER 30 Ca 0.16 -0.03 0.09 0.00 0.48 0.00 0.00 55.95 56.65 2fip s SER 30 Cb 0.19 0.59 0.62 0.00 0.10 0.00 0.00 66.02 67.52 2fip s SER 30 CO 0.54 -0.95 1.80 -0.08 0.98 0.00 0.00 173.24 175.53 2fip h GLU 31 N 2.05 0.18 -0.07 4.02 4.81 -1.91 -2.07 114.58 121.59 2fip h GLU 31 Ca -0.34 -0.07 0.01 0.00 -0.13 0.00 0.00 59.36 58.83 2fip h GLU 31 Cb 1.30 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.66 2fip h GLU 31 CO 0.39 0.48 0.02 1.25 -0.73 0.00 0.00 179.01 180.42 2fip h LEU 32 N 0.16 0.03 -0.51 1.64 5.85 -1.95 -1.01 115.31 119.50 2fip h LEU 32 Ca 0.02 0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.64 2fip h LEU 32 Cb 0.64 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 2fip h LEU 32 CO 0.05 0.03 -0.10 1.88 -0.34 0.00 0.00 178.44 179.95 2fip h TYR 33 N 0.06 1.09 -0.61 1.25 0.05 -1.86 -1.34 116.97 115.61 2fip h TYR 33 Ca 0.03 -0.23 0.04 0.00 0.05 0.00 0.00 58.73 58.62 2fip h TYR 33 Cb 0.01 -0.27 -0.05 0.00 1.01 0.00 0.00 36.73 37.44 2fip h TYR 33 CO -0.09 1.03 0.35 1.25 -1.05 0.00 0.00 178.16 179.64 2fip h LEU 34 N 0.84 0.54 -0.84 3.88 5.85 -1.20 -1.59 115.31 122.79 2fip h LEU 34 Ca 0.13 0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.75 2fip h LEU 34 Cb 0.66 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 2fip h LEU 34 CO 0.05 0.37 -0.54 0.78 -0.34 0.00 0.00 178.44 178.76 2fip h ASN 35 N 0.67 0.12 -0.56 1.25 2.35 -1.04 -1.88 115.58 116.49 2fip h ASN 35 Ca 0.26 -0.06 -0.10 0.00 -0.55 0.00 0.00 56.30 55.85 2fip h ASN 35 Cb 0.10 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 2fip h ASN 35 CO -0.14 0.64 -0.02 0.50 -1.65 0.00 0.00 177.43 176.76 2fip h LYS 36 N 0.09 1.00 0.00 0.81 3.64 -0.74 -0.19 116.57 121.18 2fip h LYS 36 Ca -0.00 -0.33 -0.00 0.00 -1.27 0.00 0.00 60.65 59.05 2fip h LYS 36 Cb 0.98 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.71 2fip h LYS 36 CO 0.08 1.01 -0.00 0.35 -2.27 0.00 0.00 179.45 178.62 2fip h PHE 37 N 0.89 -0.00 -0.67 1.91 3.04 -1.13 -2.23 116.94 118.74 2fip h PHE 37 Ca 0.16 -0.00 -0.03 0.00 3.98 0.00 0.00 57.97 62.08 2fip h PHE 37 Cb 0.57 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.05 2fip h PHE 37 CO 0.04 0.25 0.31 -0.07 -2.02 0.00 0.00 178.31 176.82 2fip h LEU 38 N -0.25 0.87 0.00 0.59 3.38 -1.23 -1.35 115.31 117.32 2fip h LEU 38 Ca -0.00 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2fip h LEU 38 Cb 0.25 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2fip h LEU 38 CO 0.00 0.75 -0.04 0.47 0.09 0.00 0.00 178.44 179.71 2fip n ASP 39 N -4.33 0.29 0.00 -0.43 10.43 -0.09 -4.29 116.55 118.12 2fip n ASP 39 Ca 0.06 0.47 0.00 0.00 2.57 0.00 0.00 54.79 57.90 2fip n ASP 39 Cb 0.14 -0.53 0.00 0.00 1.84 0.00 0.00 41.12 42.57 2fip n ASP 39 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2fip n GLY 40 N 1.44 0.01 0.26 0.44 0.00 -0.84 -4.81 105.19 101.68 2fip n GLY 40 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.07 2fip n GLY 40 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2fip h TYR 41 N 0.00 0.52 -0.38 1.61 -0.00 -1.44 -0.42 116.97 116.86 2fip h TYR 41 Ca 0.00 -0.07 -0.06 0.00 0.00 0.00 0.00 58.73 58.61 2fip h TYR 41 Cb 0.16 -0.14 -0.01 0.00 0.00 0.00 0.00 36.73 36.73 2fip h TYR 41 CO 0.00 0.57 0.02 1.96 -0.00 0.00 0.00 178.16 180.71 2fip h GLN 42 N 0.46 0.65 -0.23 0.10 4.20 -1.85 -1.21 115.11 117.24 2fip h GLN 42 Ca 0.09 -0.20 -0.13 0.00 0.06 0.00 0.00 58.65 58.47 2fip h GLN 42 Cb 0.43 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2fip h GLN 42 CO 0.02 0.74 -0.41 1.49 -0.67 0.00 0.00 178.83 180.00 2fip h GLU 43 N 0.48 0.54 -0.52 1.46 4.57 -1.85 -2.88 114.58 116.37 2fip h GLU 43 Ca 0.11 -0.28 -0.05 0.00 -1.18 0.00 0.00 59.36 57.96 2fip h GLU 43 Cb 0.43 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.01 2fip h GLU 43 CO 0.02 0.86 0.12 -0.92 -1.18 0.00 0.00 179.01 177.90 2fip h TYR 44 N 0.44 0.82 -0.99 0.92 3.20 -0.82 -2.34 116.97 118.20 2fip h TYR 44 Ca 0.04 -0.08 0.05 0.00 3.14 0.00 0.00 58.73 61.88 2fip h TYR 44 Cb 0.91 -0.24 -0.06 0.00 1.54 0.00 0.00 36.73 38.88 2fip h TYR 44 CO 0.04 0.70 0.64 0.00 -1.64 0.00 0.00 178.16 177.90 2fip h ARG 45 N 0.77 1.16 -0.43 1.82 3.08 -1.00 0.56 114.38 120.34 2fip h ARG 45 Ca 0.17 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 60.08 2fip h ARG 45 Cb 0.30 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 2fip h ARG 45 CO -0.00 0.77 -0.01 0.87 -1.07 0.00 0.00 179.97 180.53 2fip h LYS 46 N 1.20 0.76 -0.45 0.04 1.57 -1.41 -0.21 116.57 118.06 2fip h LYS 46 Ca 0.42 -0.25 -0.14 0.00 -1.87 0.00 0.00 60.65 58.81 2fip h LYS 46 Cb 0.10 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 2fip h LYS 46 CO -0.15 0.83 -0.27 0.87 -0.57 0.00 0.00 179.45 180.16 2fip h LYS 47 N 0.59 0.98 -0.05 3.15 1.57 -1.15 -2.44 116.57 119.22 2fip h LYS 47 Ca 0.12 -0.44 -0.01 0.00 -1.87 0.00 0.00 60.65 58.45 2fip h LYS 47 Cb 0.50 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.79 2fip h LYS 47 CO 0.02 1.11 0.00 0.35 -0.57 0.00 0.00 179.45 180.37 2fip h PHE 48 N 0.83 0.09 -0.30 -1.35 3.57 -0.83 -1.37 116.94 117.59 2fip h PHE 48 Ca 0.10 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.61 2fip h PHE 48 Cb 0.85 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.55 2fip h PHE 48 CO 0.06 0.35 0.20 -0.97 -2.23 0.00 0.00 178.31 175.72 2fip h ASN 49 N -0.19 0.24 -0.14 0.41 -0.73 -1.05 -0.48 115.58 113.64 2fip h ASN 49 Ca 0.01 -0.00 -0.13 0.00 1.87 0.00 0.00 56.30 58.05 2fip h ASN 49 Cb 0.31 -0.06 0.00 0.00 0.27 0.00 0.00 38.32 38.85 2fip h ASN 49 CO 0.00 0.16 -0.42 0.50 -0.37 0.00 0.00 177.43 177.31 2fip h LYS 50 N 0.28 0.52 -0.54 6.67 3.64 -1.21 -1.62 116.57 124.31 2fip h LYS 50 Ca 0.12 -0.38 -0.01 0.00 -1.27 0.00 0.00 60.65 59.11 2fip h LYS 50 Cb 0.15 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 2fip h LYS 50 CO -0.02 1.00 0.30 0.87 -2.27 0.00 0.00 179.45 179.32 2fip h LYS 51 N 0.14 0.75 -0.20 1.90 1.57 -0.34 -2.52 116.57 117.87 2fip h LYS 51 Ca -0.01 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 2fip h LYS 51 Cb 1.04 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 2fip h LYS 51 CO 0.09 0.58 0.04 0.82 -0.57 0.00 0.00 179.45 180.41 2fip h ILE 52 N 0.72 1.21 -0.89 1.86 1.08 -1.15 -2.83 117.51 117.52 2fip h ILE 52 Ca 0.19 -0.69 0.22 0.00 -0.39 0.00 0.00 64.86 64.19 2fip h ILE 52 Cb 0.05 1.29 -0.06 0.00 -3.07 0.00 0.00 36.82 35.03 2fip h ILE 52 CO -0.03 0.21 0.60 -0.08 -0.69 0.00 0.00 178.15 178.17 2fip h GLU 53 N 0.13 0.26 0.00 2.37 4.81 -1.11 0.50 114.58 121.54 2fip h GLU 53 Ca 0.06 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2fip h GLU 53 Cb 0.29 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.60 2fip h GLU 53 CO 0.00 0.17 -0.13 0.00 -0.73 0.00 0.00 179.01 178.32 2fip h ARG 54 N 0.26 0.00 0.10 1.92 3.08 -1.19 -3.20 114.38 115.35 2fip h ARG 54 Ca 0.45 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 60.15 2fip h ARG 54 Cb 1.34 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.37 2fip h ARG 54 CO -0.12 0.13 -1.93 0.28 -1.07 0.00 0.00 179.97 177.26 2fip n VAL 55 N -3.26 1.73 -3.65 2.04 0.31 0.15 -4.97 118.33 110.69 2fip n VAL 55 Ca 0.01 -0.56 -0.09 0.00 -0.01 0.00 0.00 64.34 63.69 2fip n VAL 55 Cb 0.40 -1.76 -0.07 0.00 -0.91 0.00 0.00 33.84 31.49 2fip n VAL 55 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2fip s ALA 56 N -2.53 -1.76 -0.11 3.52 0.00 0.14 -5.13 121.76 115.90 2fip s ALA 56 Ca -0.24 2.22 -0.24 0.00 0.00 0.00 0.00 51.96 53.69 2fip s ALA 56 Cb 0.07 -1.30 -0.03 0.00 0.00 0.00 0.00 23.12 21.86 2fip s ALA 56 CO 0.73 -0.35 0.75 0.08 0.00 0.00 0.00 175.76 176.97 2fip s VAL 57 N 1.27 4.98 0.16 0.00 1.01 -1.26 -4.05 120.40 122.52 2fip s VAL 57 Ca -0.07 1.52 0.01 0.00 0.00 0.00 0.00 61.98 63.43 2fip s VAL 57 Cb -0.05 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 2fip s VAL 57 CO -0.14 0.16 0.02 0.42 0.00 0.00 0.00 175.10 175.57 2fip s THR 58 N 1.35 0.47 -2.16 3.92 -4.23 -1.26 -5.02 115.64 108.72 2fip s THR 58 Ca 0.38 -1.95 0.18 0.00 -1.18 0.00 0.00 61.69 59.11 2fip s THR 58 Cb -0.17 -2.10 0.43 0.00 1.34 0.00 0.00 72.50 72.00 2fip s THR 58 CO 0.16 -0.47 1.52 -0.81 -0.54 0.00 0.00 174.62 174.48 2fip n PRO 59 N -0.19 1.52 -2.57 3.99 -0.04 -1.26 -4.93 135.00 131.53 2fip n PRO 59 Ca -0.06 -0.79 -0.27 0.00 -0.04 0.00 0.00 63.50 62.33 2fip n PRO 59 Cb 0.63 -1.33 0.01 0.00 -0.04 0.00 0.00 33.50 32.77 2fip n PRO 59 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2fip s TRP 60 N -1.82 3.45 -0.43 0.54 0.23 -1.26 -5.06 118.94 114.59 2fip s TRP 60 Ca 0.28 0.74 -0.07 0.00 -2.03 0.00 0.00 56.10 55.02 2fip s TRP 60 Cb 0.15 -2.44 0.10 0.00 0.03 0.00 0.00 33.47 31.30 2fip s TRP 60 CO 0.22 -0.46 0.26 1.21 0.96 0.00 0.00 176.95 179.14 2fip s ASN 61 N -4.18 5.54 -0.33 2.95 3.04 -1.20 -4.98 114.94 115.78 2fip s ASN 61 Ca 0.50 -1.73 0.02 0.00 0.04 0.00 0.00 52.86 51.69 2fip s ASN 61 Cb -0.10 -1.95 0.41 0.00 -1.54 0.00 0.00 41.25 38.07 2fip s ASN 61 CO 0.45 -0.57 1.70 0.23 -3.04 0.00 0.00 177.10 175.87 2fip n MET 62 N 4.83 1.89 -0.21 0.43 2.81 -1.26 -4.59 117.12 121.01 2fip n MET 62 Ca -0.08 -2.03 -0.04 0.00 -1.81 0.00 0.00 57.70 53.74 2fip n MET 62 Cb 0.42 -1.80 0.07 0.00 -0.71 0.00 0.00 33.22 31.20 2fip n MET 62 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 2fip h ASP 63 N 0.88 0.59 -0.44 7.83 3.32 -1.93 -1.44 116.42 125.23 2fip h ASP 63 Ca 0.42 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.40 2fip h ASP 63 Cb 1.94 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 41.35 2fip h ASP 63 CO 0.81 0.41 -0.00 -0.03 -1.72 0.00 0.00 179.24 178.70 2fip h MET 64 N 0.72 0.85 -0.63 3.56 4.05 -1.91 0.82 114.93 122.40 2fip h MET 64 Ca 0.26 -0.24 -0.06 0.00 -0.28 0.00 0.00 59.70 59.37 2fip h MET 64 Cb 0.06 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 30.74 2fip h MET 64 CO -0.12 0.86 0.14 1.25 0.23 0.00 0.00 176.91 179.27 2fip h LEU 65 N 0.79 0.94 -0.74 3.39 5.85 -1.77 -0.40 115.31 123.36 2fip h LEU 65 Ca 0.15 -0.19 -0.07 0.00 0.84 0.00 0.00 57.88 58.61 2fip h LEU 65 Cb 0.48 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 2fip h LEU 65 CO 0.02 0.91 0.19 0.00 -0.34 0.00 0.00 178.44 179.22 2fip h ALA 66 N 1.20 0.97 -0.46 1.25 0.00 -0.49 -1.07 119.26 120.66 2fip h ALA 66 Ca 0.20 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2fip h ALA 66 Cb 0.35 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2fip h ALA 66 CO 0.00 0.67 0.20 -0.44 0.00 0.00 0.00 179.25 179.68 2fip h ASP 67 N 1.08 0.62 -0.53 0.00 3.32 -0.06 0.17 116.42 121.03 2fip h ASP 67 Ca 0.23 -0.15 -0.04 0.00 0.02 0.00 0.00 57.03 57.09 2fip h ASP 67 Cb 0.36 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 2fip h ASP 67 CO -0.00 0.60 0.19 0.40 -1.72 0.00 0.00 179.24 178.71 2fip h ILE 68 N 0.60 1.23 -0.62 0.35 2.04 -0.93 -0.47 117.51 119.70 2fip h ILE 68 Ca 0.15 -0.74 -0.06 0.00 1.00 0.00 0.00 64.86 65.21 2fip h ILE 68 Cb 0.16 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 2fip h ILE 68 CO -0.02 0.28 0.14 0.74 0.00 0.00 0.00 178.15 179.29 2fip h THR 69 N 0.73 1.25 -0.27 -0.27 2.02 -0.83 -1.72 112.91 113.81 2fip h THR 69 Ca 0.17 -0.92 -0.16 0.00 0.77 0.00 0.00 66.41 66.27 2fip h THR 69 Cb 0.24 0.62 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 2fip h THR 69 CO -0.01 0.35 -0.47 0.15 0.37 0.00 0.00 175.52 175.91 2fip h PHE 70 N 0.94 0.99 -0.55 3.16 3.57 -0.40 -2.46 116.94 122.19 2fip h PHE 70 Ca 0.20 -0.35 0.04 0.00 3.53 0.00 0.00 57.97 61.39 2fip h PHE 70 Cb 0.35 -0.19 -0.04 0.00 2.79 0.00 0.00 35.95 38.86 2fip h PHE 70 CO 0.02 1.15 0.30 -0.92 -2.23 0.00 0.00 178.31 176.64 2fip h TYR 71 N 0.55 0.55 0.00 0.41 3.20 -0.88 0.19 116.97 120.99 2fip h TYR 71 Ca 0.02 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 2fip h TYR 71 Cb 1.07 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 39.17 2fip h TYR 71 CO 0.08 0.29 -0.14 0.77 -1.64 0.00 0.00 178.16 177.51 2fip h SER 72 N 0.58 0.00 0.29 -2.11 0.02 -1.19 -0.11 113.55 111.02 2fip h SER 72 Ca 0.24 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.85 2fip h SER 72 Cb 0.11 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.67 2fip h SER 72 CO -0.14 0.14 -1.57 -0.08 -1.14 0.00 0.00 176.83 174.04 2fip h GLU 73 N 0.00 0.44 0.03 3.45 4.81 -0.76 -3.39 114.58 119.16 2fip h GLU 73 Ca -0.00 -0.76 -0.00 0.00 -0.13 0.00 0.00 59.36 58.47 2fip h GLU 73 Cb 0.28 0.28 0.00 0.00 0.63 0.00 0.00 28.75 29.95 2fip h GLU 73 CO 0.02 1.35 -0.02 0.28 -0.73 0.00 0.00 179.01 179.91 2fip h VAL 74 N 0.12 1.39 -3.16 0.32 2.07 -0.35 -3.42 116.25 113.21 2fip h VAL 74 Ca -0.28 -1.53 -0.57 0.00 0.82 0.00 0.00 66.70 65.14 2fip h VAL 74 Cb 2.12 2.38 -0.05 0.00 -1.52 0.00 0.00 31.29 34.21 2fip h VAL 74 CO 0.23 0.38 0.89 -0.70 0.02 0.00 0.00 177.57 178.39 2fip s GLU 75 N -3.37 4.07 0.00 1.57 2.56 -0.08 -4.89 118.70 118.55 2fip s GLU 75 Ca -0.16 1.27 0.23 0.00 0.00 0.00 0.00 54.97 56.31 2fip s GLU 75 Cb -0.00 -3.78 0.12 0.00 2.00 0.00 0.00 34.13 32.46 2fip s GLU 75 CO 0.63 -0.91 1.18 1.63 -0.56 0.00 0.00 175.26 177.22 2fip n LYS 76 N 6.92 1.51 -0.82 4.30 4.76 -1.26 -4.44 118.16 129.12 2fip n LYS 76 Ca 0.13 -1.23 -0.03 0.00 -2.87 0.00 0.00 58.31 54.31 2fip n LYS 76 Cb 0.46 -1.47 0.20 0.00 -1.84 0.00 0.00 35.03 32.37 2fip n LYS 76 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2fip n ARG 77 N 0.32 1.84 0.00 1.97 1.74 -1.26 -5.08 116.66 116.19 2fip n ARG 77 Ca 0.11 -3.25 0.00 0.00 -0.77 0.00 0.00 57.85 53.94 2fip n ARG 77 Cb 0.50 -1.80 0.00 0.00 -1.02 0.00 0.00 32.46 30.14 2fip n ARG 77 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2fip n GLY 78 N -1.11 0.59 2.89 -0.13 0.00 -1.26 -4.82 105.19 101.35 2fip n GLY 78 Ca 0.31 -2.22 -0.22 0.00 0.00 0.00 0.00 46.02 43.90 2fip n GLY 78 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2fip s PHE 79 N -0.68 0.88 -0.20 1.61 5.36 -1.26 -4.87 117.98 118.81 2fip s PHE 79 Ca 0.00 -0.29 -0.08 0.00 -0.96 0.00 0.00 56.93 55.60 2fip s PHE 79 Cb 0.00 -0.78 0.08 0.00 -0.34 0.00 0.00 43.02 41.98 2fip s PHE 79 CO 0.00 -0.25 0.44 -1.58 -1.46 0.00 0.00 175.22 172.37 2fip s HIS 80 N 1.13 -0.79 0.10 10.12 2.46 -1.26 -5.03 115.29 122.03 2fip s HIS 80 Ca -0.07 1.53 -0.05 0.00 0.47 0.00 0.00 55.06 56.94 2fip s HIS 80 Cb -0.14 0.34 -0.02 0.00 -0.13 0.00 0.00 32.58 32.63 2fip s HIS 80 CO -0.01 -0.46 0.11 0.00 -2.47 0.00 0.00 174.74 171.91 2fip s ALA 81 N 2.23 0.28 0.12 1.58 0.00 -1.26 -1.96 121.76 122.76 2fip s ALA 81 Ca -0.05 -1.04 0.09 0.00 0.00 0.00 0.00 51.96 50.96 2fip s ALA 81 Cb -0.11 0.57 -0.04 0.00 0.00 0.00 0.00 23.12 23.55 2fip s ALA 81 CO -0.13 -0.49 -0.21 -1.58 0.00 0.00 0.00 175.76 173.35 2fip s TRP 82 N -3.94 1.86 -0.07 0.00 0.52 -0.23 -0.55 118.94 116.53 2fip s TRP 82 Ca 0.12 -0.43 0.01 0.00 0.02 0.00 0.00 56.10 55.82 2fip s TRP 82 Cb 0.06 -0.99 0.02 0.00 -1.15 0.00 0.00 33.47 31.41 2fip s TRP 82 CO -0.06 0.26 -0.07 -1.17 0.02 0.00 0.00 176.95 175.93 2fip s LEU 83 N -2.13 1.34 -1.67 2.99 2.96 0.13 -1.48 118.68 120.81 2fip s LEU 83 Ca 0.10 -0.21 -0.18 0.00 -0.22 0.00 0.00 54.13 53.62 2fip s LEU 83 Cb -0.09 -0.64 0.14 0.00 0.50 0.00 0.00 46.19 46.10 2fip s LEU 83 CO 0.05 -0.05 0.83 2.29 -1.32 0.00 0.00 176.35 178.15 2fip n LYS 84 N 4.23 -3.67 0.00 1.98 2.85 -0.20 -1.11 118.16 122.25 2fip n LYS 84 Ca -0.20 0.42 0.00 0.00 -1.05 0.00 0.00 58.31 57.48 2fip n LYS 84 Cb 0.51 -5.18 0.00 0.00 -0.65 0.00 0.00 35.03 29.70 2fip n LYS 84 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2fip n GLY 85 N -1.46 2.13 3.64 2.58 0.00 -1.26 -5.04 105.19 105.78 2fip n GLY 85 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 2fip n GLY 85 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2fip s ASP 86 N -3.01 4.64 0.26 1.61 1.01 -0.27 -5.04 116.67 115.86 2fip s ASP 86 Ca 0.00 -0.47 -0.31 0.00 0.71 0.00 0.00 52.55 52.48 2fip s ASP 86 Cb 0.00 -0.93 -0.12 0.00 1.01 0.00 0.00 42.92 42.88 2fip s ASP 86 CO 0.00 0.07 1.62 0.59 0.21 0.00 0.00 175.17 177.66 2fip n ASN 87 N -0.24 3.78 -4.14 0.27 4.13 -1.26 0.21 115.26 118.00 2fip n ASN 87 Ca -0.09 1.12 -0.26 0.00 1.68 0.00 0.00 54.58 57.03 2fip n ASN 87 Cb 0.56 -1.57 -0.16 0.00 -1.54 0.00 0.00 39.78 37.07 2fip n ASN 87 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2fip s ALA 88 N 0.37 1.49 0.78 5.41 0.00 0.28 -4.72 121.76 125.37 2fip s ALA 88 Ca 0.68 -0.69 -0.12 0.00 0.00 0.00 0.00 51.96 51.84 2fip s ALA 88 Cb -0.52 -0.47 0.06 0.00 0.00 0.00 0.00 23.12 22.19 2fip s ALA 88 CO 0.43 0.29 1.11 0.95 0.00 0.00 0.00 175.76 178.54 2fip s THR 89 N -0.04 3.06 0.25 0.00 -4.23 -1.26 -4.06 115.64 109.34 2fip s THR 89 Ca -0.02 0.34 -0.04 0.00 -1.18 0.00 0.00 61.69 60.80 2fip s THR 89 Cb -0.10 -3.19 0.21 0.00 1.34 0.00 0.00 72.50 70.76 2fip s THR 89 CO 0.02 -0.45 1.79 -0.25 -0.54 0.00 0.00 174.62 175.19 2fip h TRP 90 N -0.97 0.78 -0.25 3.99 7.01 -1.97 -1.29 115.95 123.24 2fip h TRP 90 Ca -0.46 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 60.53 2fip h TRP 90 Cb 1.27 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 28.10 2fip h TRP 90 CO 0.45 0.27 0.03 -0.09 -2.79 0.00 0.00 178.44 176.31 2fip h ARG 91 N 0.70 0.43 -0.21 2.65 2.43 -1.99 -2.23 114.38 116.15 2fip h ARG 91 Ca 0.40 -0.12 -0.02 0.00 -0.81 0.00 0.00 59.98 59.44 2fip h ARG 91 Cb 0.45 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 2fip h ARG 91 CO -0.29 0.57 0.06 0.93 -1.51 0.00 0.00 179.97 179.74 2fip h GLU 92 N 0.23 0.30 -0.19 0.20 5.08 -1.75 -0.03 114.58 118.41 2fip h GLU 92 Ca 0.08 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.24 2fip h GLU 92 Cb 0.36 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 2fip h GLU 92 CO 0.01 0.27 -0.56 0.28 -1.00 0.00 0.00 179.01 178.00 2fip h VAL 93 N 0.30 1.32 -0.48 3.13 2.07 -1.08 -2.13 116.25 119.38 2fip h VAL 93 Ca 0.07 -1.81 -0.09 0.00 0.82 0.00 0.00 66.70 65.70 2fip h VAL 93 Cb 0.10 1.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 2fip h VAL 93 CO -0.01 0.57 -0.05 0.45 0.02 0.00 0.00 177.57 178.55 2fip h HIS 94 N 0.45 0.90 -0.55 1.57 3.86 -0.62 -0.96 115.15 119.80 2fip h HIS 94 Ca 0.01 -0.15 -0.04 0.00 -1.16 0.00 0.00 60.37 59.03 2fip h HIS 94 Cb 1.12 -0.24 -0.03 0.00 1.06 0.00 0.00 27.41 29.32 2fip h HIS 94 CO 0.05 0.85 0.18 0.28 0.86 0.00 0.00 177.93 180.15 2fip h VAL 95 N 0.76 1.21 -0.45 2.45 2.07 -0.83 -1.91 116.25 119.56 2fip h VAL 95 Ca 0.14 -0.71 -0.08 0.00 0.82 0.00 0.00 66.70 66.87 2fip h VAL 95 Cb 0.53 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 2fip h VAL 95 CO 0.03 0.27 -0.04 0.22 0.02 0.00 0.00 177.57 178.08 2fip h TYR 96 N 0.80 0.91 -0.02 1.57 3.20 -0.88 -2.46 116.97 120.08 2fip h TYR 96 Ca 0.19 -0.17 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 2fip h TYR 96 Cb 0.21 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.25 2fip h TYR 96 CO 0.01 0.89 -0.11 0.00 -1.64 0.00 0.00 178.16 177.31 2fip h ALA 97 N 0.90 1.78 -0.07 1.82 0.00 -0.62 -1.14 119.26 121.93 2fip h ALA 97 Ca 0.12 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 2fip h ALA 97 Cb 0.55 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.32 2fip h ALA 97 CO 0.03 0.16 -0.43 -0.07 0.00 0.00 0.00 179.25 178.94 2fip h LEU 98 N 0.03 0.51 -0.99 0.00 3.38 -1.17 -2.84 115.31 114.24 2fip h LEU 98 Ca 0.00 -0.66 -0.10 0.00 0.09 0.00 0.00 57.88 57.21 2fip h LEU 98 Cb 0.21 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2fip h LEU 98 CO 0.01 1.09 -0.35 -0.09 0.09 0.00 0.00 178.44 179.20 2fip h ARG 99 N -0.04 0.29 -0.00 1.13 2.43 -1.07 -3.00 114.38 114.13 2fip h ARG 99 Ca -0.03 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 2fip h ARG 99 Cb 1.09 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 2fip h ARG 99 CO 0.09 0.61 -0.37 1.51 -1.51 0.00 0.00 179.97 180.30 2fip n ILE 100 N -4.07 0.00 0.27 1.20 0.00 -0.46 -4.06 119.36 112.24 2fip n ILE 100 Ca -0.01 -0.00 0.11 0.00 0.00 0.00 0.00 62.75 62.84 2fip n ILE 100 Cb 0.44 0.07 0.74 0.00 0.00 0.00 0.00 39.64 40.89 2fip n ILE 100 CO 0.00 0.00 0.00 -0.03 0.00 0.00 0.00 176.55 176.52 2fip h MET 101 N 0.04 0.00 -0.07 9.51 4.05 -1.35 -2.01 114.93 125.10 2fip h MET 101 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2fip h MET 101 Cb 0.50 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.30 2fip h MET 101 CO 0.00 0.00 0.00 0.25 0.23 0.00 0.00 176.91 177.39 2fip n THR 102 N -4.29 0.08 -3.03 -0.77 -2.24 -1.26 -3.24 114.28 99.54 2fip n THR 102 Ca -0.03 -0.18 -0.40 0.00 -2.27 0.00 0.00 64.05 61.18 2fip n THR 102 Cb 0.09 0.07 -0.05 0.00 -2.10 0.00 0.00 70.33 68.35 2fip n THR 102 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2fip s LYS 103 N -1.92 4.45 0.18 -0.78 3.01 -0.76 -4.98 119.74 118.95 2fip s LYS 103 Ca 0.34 0.95 -0.12 0.00 -1.01 0.00 0.00 55.97 56.13 2fip s LYS 103 Cb 0.17 -3.41 0.10 0.00 -1.01 0.00 0.00 37.83 33.68 2fip s LYS 103 CO 0.27 0.16 1.80 -1.00 0.51 0.00 0.00 175.35 177.09 2fip h PRO 104 N 6.29 0.88 -6.52 -1.68 0.13 -1.89 -3.44 132.00 125.77 2fip h PRO 104 Ca -0.42 -0.10 -0.52 0.00 -0.87 0.00 0.00 66.00 64.08 2fip h PRO 104 Cb 1.20 -0.17 -0.03 0.00 0.13 0.00 0.00 31.00 32.13 2fip h PRO 104 CO 0.73 0.66 -0.06 -0.80 -0.23 0.00 0.00 178.00 178.31 2fip s ASN 105 N -5.94 6.65 -0.09 1.44 0.01 -1.26 -5.04 114.94 110.71 2fip s ASN 105 Ca -0.13 1.00 0.03 0.00 -0.71 0.00 0.00 52.86 53.05 2fip s ASN 105 Cb 0.13 -2.26 -0.02 0.00 0.41 0.00 0.00 41.25 39.52 2fip s ASN 105 CO 0.78 -0.12 -0.17 -0.89 -1.51 0.00 0.00 177.10 175.18 2fip s THR 106 N -1.89 2.73 0.09 1.60 2.01 -1.26 -5.10 115.64 113.81 2fip s THR 106 Ca 0.49 -0.81 -0.30 0.00 0.31 0.00 0.00 61.69 61.38 2fip s THR 106 Cb -0.11 -2.08 -0.05 0.00 0.01 0.00 0.00 72.50 70.26 2fip s THR 106 CO 0.21 0.56 1.00 -0.76 -0.69 0.00 0.00 174.62 174.94 2fip s LEU 107 N -0.08 4.46 0.62 4.42 1.43 -1.26 -5.05 118.68 123.22 2fip s LEU 107 Ca -0.04 1.82 -0.02 0.00 -1.03 0.00 0.00 54.13 54.86 2fip s LEU 107 Cb -0.14 -3.59 0.05 0.00 0.03 0.00 0.00 46.19 42.55 2fip s LEU 107 CO 0.04 -0.16 0.88 -1.81 0.23 0.00 0.00 176.35 175.53 2fip s ASP 108 N 0.31 5.00 -0.05 2.29 1.01 -1.26 -4.98 116.67 118.99 2fip s ASP 108 Ca 0.49 0.10 0.01 0.00 0.71 0.00 0.00 52.55 53.86 2fip s ASP 108 Cb -0.24 -0.85 -0.03 0.00 1.01 0.00 0.00 42.92 42.81 2fip s ASP 108 CO 0.30 -1.38 -0.05 0.26 0.21 0.00 0.00 175.17 174.51 2fip s TRP 109 N -2.97 2.98 0.04 4.23 0.52 -1.26 -4.21 118.94 118.26 2fip s TRP 109 Ca 0.59 0.04 -0.00 0.00 0.02 0.00 0.00 56.10 56.76 2fip s TRP 109 Cb -0.10 -1.70 -0.03 0.00 -1.15 0.00 0.00 33.47 30.49 2fip s TRP 109 CO 0.41 0.37 -0.03 -1.12 0.02 0.00 0.00 176.95 176.60 2fip s SER 110 N -1.00 0.40 0.37 2.95 0.01 -0.37 -4.95 113.70 111.12 2fip s SER 110 Ca 0.14 -0.74 -0.26 0.00 1.31 0.00 0.00 55.95 56.41 2fip s SER 110 Cb -0.11 0.14 -0.09 0.00 0.21 0.00 0.00 66.02 66.17 2fip s SER 110 CO 0.03 -0.43 1.08 -0.60 0.41 0.00 0.00 173.24 173.73 2fip s ARG 111 N -2.62 4.27 0.16 12.44 3.52 -1.26 -0.88 118.95 134.58 2fip s ARG 111 Ca -0.05 1.64 -0.00 0.00 -0.13 0.00 0.00 55.73 57.19 2fip s ARG 111 Cb -0.02 -2.74 -0.04 0.00 -1.56 0.00 0.00 34.95 30.60 2fip s ARG 111 CO -0.05 -0.08 0.07 0.96 -0.81 0.00 0.00 175.30 175.39 2fip s ILE 112 N -1.48 0.20 0.26 4.11 -4.36 -0.80 -4.88 121.20 114.24 2fip s ILE 112 Ca 0.54 -1.95 -0.17 0.00 -0.26 0.00 0.00 60.65 58.82 2fip s ILE 112 Cb -0.26 -2.20 -0.08 0.00 1.25 0.00 0.00 42.46 41.17 2fip s ILE 112 CO 0.33 -0.33 0.71 -1.10 0.24 0.00 0.00 174.94 174.79 2fip s GLN 113 N -4.05 4.11 0.13 0.37 -1.52 -1.26 -4.27 119.66 113.17 2fip s GLN 113 Ca 0.28 0.73 -0.32 0.00 -1.95 0.00 0.00 55.36 54.10 2fip s GLN 113 Cb 0.07 -2.69 -0.12 0.00 -0.22 0.00 0.00 33.01 30.06 2fip s GLN 113 CO 0.05 0.30 1.75 1.17 -0.25 0.00 0.00 175.29 178.31 2fip n LYS 114 N 0.24 2.54 -1.80 2.91 4.81 -1.26 -4.90 118.16 120.70 2fip n LYS 114 Ca 0.00 0.92 -0.40 0.00 -0.87 0.00 0.00 58.31 57.96 2fip n LYS 114 Cb 0.52 -2.77 0.01 0.00 0.02 0.00 0.00 35.03 32.81 2fip n LYS 114 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 2fip s PRO 115 N 2.04 3.92 0.00 1.64 0.02 -1.26 -5.17 135.00 136.19 2fip s PRO 115 Ca 0.81 2.51 0.00 0.00 0.02 0.00 0.00 61.00 64.34 2fip s PRO 115 Cb -0.57 -2.83 0.00 0.00 0.02 0.00 0.00 34.50 31.13 2fip s PRO 115 CO 0.38 -0.66 0.00 0.54 -0.33 0.00 0.00 177.00 176.93